ethyl 2-[(4-bromanyl-1-ethyl-pyrazol-3-yl)carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-bromanyl-1-ethyl-pyrazol-3-yl)carbonylamino]-5-ethanoyl-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[(4-bromo-1-ethyl-pyrazole-3-carbonyl)amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[(4-bromo-1-ethyl-3-pyrazolyl)-oxomethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[(4-bromo-1-ethylpyrazole-3-carbonyl)amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[(4-bromo-1-ethyl-pyrazole-3-carbonyl)amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C16H18BrN3O4S MolecularWeight: 428.30082

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=C(C(=C(S2)C(=O)C)C)C(=O)OCC)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=C(C(=C(S2)C(=O)C)C)C(=O)OCC)Br

InChI

InChI=1S/C16H18BrN3O4S/c1-5-20-7-10(17)12(19-20)14(22)18-15-11(16(23)24-6-2)8(3)13(25-15)9(4)21/h7H,5-6H2,1-4H3,(H,18,22)